tert-butyl N-[(2R,3R)-3-amino-1-methoxybutan-2-yl]carbamate

C10H22N2O3 — CID 131733528

IUPACtert-butyl N-[(2R,3R)-3-amino-1-methoxybutan-2-yl]carbamate
SMILESCOC[C@H](NC(=O)OC(C)(C)C)[C@@H](C)N
InChIInChI=1S/C10H22N2O3/c1-7(11)8(6-14-5)12-9(13)15-10(2,3)4/h7-8H,6,11H2,1-5H3,(H,12,13)/t7-,8+/m1/s1
InChIKeyDAIWDSNRLMDMBA-SFYZADRCSA-N
MW218.30 g/mol
LogP0.87
Rot. Bonds4

About tert-butyl N-[(2R,3R)-3-amino-1-methoxybutan-2-yl]carbamate

tert-butyl N-[(2R,3R)-3-amino-1-methoxybutan-2-yl]carbamate (PubChem CID 131733528) has the molecular formula C10H22N2O3 and a molecular weight of 218.30 g/mol. Its IUPAC name is tert-butyl N-[(2R,3R)-3-amino-1-methoxybutan-2-yl]carbamate.

Molecular Properties

Compound Nametert-butyl N-[(2R,3R)-3-amino-1-methoxybutan-2-yl]carbamate
PubChem CID131733528
Molecular FormulaC10H22N2O3
Molecular Weight218.30 g/mol
Exact Mass218.16
IUPAC Nametert-butyl N-[(2R,3R)-3-amino-1-methoxybutan-2-yl]carbamate
SMILESCOC[C@H](NC(=O)OC(C)(C)C)[C@@H](C)N
InChIInChI=1S/C10H22N2O3/c1-7(11)8(6-14-5)12-9(13)15-10(2,3)4/h7-8H,6,11H2,1-5H3,(H,12,13)/t7-,8+/m1/s1
InChIKeyDAIWDSNRLMDMBA-SFYZADRCSA-N
XLogP0.87
TPSA73.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.30
LogP ≤ 50.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze tert-butyl N-[(2R,3R)-3-amino-1-methoxybutan-2-yl]carbamate with MolForge

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Related Compounds

tert-butyl N-[(2S,3R)-3-amino-1-[tert-butyl(dimethyl)silyl]oxybutan-2-yl]carbamate
CID 58901310
methyl (2R,3R)-3-amino-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoate
CID 124652362
tert-butyl N-[(2S)-4-hydroxy-1-methoxybutan-2-yl]carbamate
CID 53259998
tert-butyl N-[(2S)-1-methoxybutan-2-yl]carbamate
CID 46941495
tert-butyl N-[1-(1-methoxypropan-2-ylamino)propan-2-yl]carbamate
CID 107247678
tert-butyl N-[(2S)-3-methyl-1-[(2S)-3-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]butyl]selanylbutan-2-yl]carbamate
CID 102155878
tert-butyl N-[(3R)-2-amino-4-methylpentan-3-yl]carbamate
CID 83350039
tert-butyl 2,4-diamino-3-[(2-methylpropan-2-yl)oxycarbonylamino]butanoate
CID 122688090
methyl 2-amino-3-[(2-methylpropan-2-yl)oxycarbonylamino]butanoate
CID 76779344
tert-butyl N-[(2R)-3-methyl-1-[[(2S)-3-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]butyl]diselanyl]butan-2-yl]carbamate
CID 139264879
tert-butyl N-[(2S)-1-iodo-3-methylbutan-2-yl]carbamate
CID 11141505
tert-butyl N-(5-aminohexan-2-yl)carbamate
CID 145220242

Frequently Asked Questions

What is the IUPAC name of tert-butyl N-[(2R,3R)-3-amino-1-methoxybutan-2-yl]carbamate?
The IUPAC name of tert-butyl N-[(2R,3R)-3-amino-1-methoxybutan-2-yl]carbamate (CID 131733528) is tert-butyl N-[(2R,3R)-3-amino-1-methoxybutan-2-yl]carbamate.
What is the SMILES notation for tert-butyl N-[(2R,3R)-3-amino-1-methoxybutan-2-yl]carbamate?
The canonical SMILES for tert-butyl N-[(2R,3R)-3-amino-1-methoxybutan-2-yl]carbamate is COC[C@H](NC(=O)OC(C)(C)C)[C@@H](C)N.
What is the InChIKey of tert-butyl N-[(2R,3R)-3-amino-1-methoxybutan-2-yl]carbamate?
The InChIKey is DAIWDSNRLMDMBA-SFYZADRCSA-N. The full InChI is InChI=1S/C10H22N2O3/c1-7(11)8(6-14-5)12-9(13)15-10(2,3)4/h7-8H,6,11H2,1-5H3,(H,12,13)/t7-,8+/m1/s1.
What are the key properties of tert-butyl N-[(2R,3R)-3-amino-1-methoxybutan-2-yl]carbamate?
tert-butyl N-[(2R,3R)-3-amino-1-methoxybutan-2-yl]carbamate has a molecular weight of 218.30 g/mol, XLogP of 0.87, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl N-[(2R,3R)-3-amino-1-methoxybutan-2-yl]carbamate is sourced from PubChem (CID 131733528), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).